4-[5-(4-chlorophenyl)furan-2-yl]-5-cyano-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylic acid

Systemtic Name: 4-[5-(4-chlorophenyl)furan-2-yl]-5-cyano-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylic acid Openeye Name: 4-[5-(4-chlorophenyl)-2-furyl]-5-cyano-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid CAS Name: 4-[5-(4-chlorophenyl)-2-furanyl]-5-cyano-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid IUPAC Name: 4-[5-(4-chlorophenyl)furan-2-yl]-5-cyano-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid Traditional Name: 4-[5-(4-chlorophenyl)-2-furyl]-5-cyano-2-keto-6-methyl-1,4-dihydropyrimidine-3-carboxylic acid Formula: C17H12ClN3O4 MolecularWeight: 357.74788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)O)C2=CC=C(O2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)O)C2=CC=C(O2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C17H12ClN3O4/c1-9-12(8-19)15(21(17(23)24)16(22)20-9)14-7-6-13(25-14)10-2-4-11(18)5-3-10/h2-7,15H,1H3,(H,20,22)(H,23,24)